1-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone

Systemtic Name: 1-[4-[(4-azanylquinazolin-2-yl)methyl]piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone Openeye Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone CAS Name: 1-[4-[(4-amino-2-quinazolinyl)methyl]-1-piperazinyl]-2-(3,5-dimethylphenoxy)ethanone IUPAC Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazin-1-yl]-2-(3,5-dimethylphenoxy)ethanone Traditional Name: 1-[4-[(4-aminoquinazolin-2-yl)methyl]piperazino]-2-(3,5-dimethylphenoxy)ethanone Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C(=N3)N)C

InChI

InChI=1S/C23H27N5O2/c1-16-11-17(2)13-18(12-16)30-15-22(29)28-9-7-27(8-10-28)14-21-25-20-6-4-3-5-19(20)23(24)26-21/h3-6,11-13H,7-10,14-15H2,1-2H3,(H2,24,25,26)